Metiapine
TL;DR: Metiapine (CAS 5800-19-1) is a chemical compound with molecular formula C19H21N3S and molecular weight 323.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methyl-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzothiazepine
Also Known As: Metiapine, Metiapina, Metiapinum, Metiapina [INN-Spanish], Metiapine [USAN:INN]
| Molecular Formula | C19H21N3S |
|---|---|
| Molecular Weight | 323.15 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 44.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 323.14563 |
| Heavy Atoms | 23 |
| Complexity | 444.0 |
Chemical Identifiers
| CAS Number | 5800-19-1 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)SC3=CC=CC=C3N=C2N4CCN(CC4)C |
| InChIKey | IOEPXYJOHIZYGQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Metiapine (CAS 5800-19-1), with molecular formula C19H21N3S and molecular weight 323.15 g/mol. IUPAC: 8-methyl-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzothiazepine.
Chemical Property Profile of Metiapine
Property Insights of Metiapine
The XLogP value of 3.3 indicates that Metiapine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.1 Ų, Metiapine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Metiapine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Metiapine?
The CAS number of Metiapine is 5800-19-1.
What is the molecular formula of Metiapine?
The molecular formula of Metiapine is C19H21N3S.
What is the molecular weight of Metiapine?
The molecular weight of Metiapine is 323.15 g/mol.
Where can I buy Metiapine?
You can request a quote for Metiapine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Metiapine?
Yes, KEHONG BIO provides custom synthesis services for Metiapine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.